1-ethyl-2,3-dimethylcyclobutan-1-amine

C8H17N — CID 123756966

IUPAC1-ethyl-2,3-dimethylcyclobutan-1-amine
SMILESCCC1(N)CC(C)C1C
InChIInChI=1S/C8H17N/c1-4-8(9)5-6(2)7(8)3/h6-7H,4-5,9H2,1-3H3
InChIKeyMPSRWWLCOAPZRF-UHFFFAOYSA-N
MW127.23 g/mol
LogP1.77
Rot. Bonds1

About 1-ethyl-2,3-dimethylcyclobutan-1-amine

1-ethyl-2,3-dimethylcyclobutan-1-amine (PubChem CID 123756966) has the molecular formula C8H17N and a molecular weight of 127.23 g/mol. Its IUPAC name is 1-ethyl-2,3-dimethylcyclobutan-1-amine.

Molecular Properties

Compound Name1-ethyl-2,3-dimethylcyclobutan-1-amine
PubChem CID123756966
Molecular FormulaC8H17N
Molecular Weight127.23 g/mol
Exact Mass127.14
IUPAC Name1-ethyl-2,3-dimethylcyclobutan-1-amine
SMILESCCC1(N)CC(C)C1C
InChIInChI=1S/C8H17N/c1-4-8(9)5-6(2)7(8)3/h6-7H,4-5,9H2,1-3H3
InChIKeyMPSRWWLCOAPZRF-UHFFFAOYSA-N
XLogP1.77
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.23
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3,3,4,5-tetramethyl-1-propylcyclohexan-1-amine
CID 66694583
ethyl 1-amino-2,3-dimethylcyclobutane-1-carboxylate
CID 130703819
2,3-dimethyl-1-propan-2-ylcyclobutan-1-amine
CID 123171488
2,3-dimethyl-1,1-dipropylcyclobutane
CID 143150497
1-ethyl-3,5-dimethylcyclohexan-1-amine
CID 64752832
2-[(2-amino-2-ethyl-4-methylcyclobutyl)methoxy]-2-methylpentane-1,4-diamine
CID 163895517
1-amino-2-ethylcyclopropan-1-ol
CID 163837248
2-methylbicyclo[1.1.1]pentan-1-amine
CID 123370149
2-(4-bromophenyl)-1-ethylcyclopropan-1-amine
CID 84701862
1-ethylcyclohexane-1,2-diamine
CID 67021542
2,3-dimethyl-1-propan-2-yl-1-propylcyclobutane
CID 123295211
(1R)-1-ethyl-1,2-dimethylcyclopropane
CID 177128711

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2,3-dimethylcyclobutan-1-amine?
The IUPAC name of 1-ethyl-2,3-dimethylcyclobutan-1-amine (CID 123756966) is 1-ethyl-2,3-dimethylcyclobutan-1-amine.
What is the SMILES notation for 1-ethyl-2,3-dimethylcyclobutan-1-amine?
The canonical SMILES for 1-ethyl-2,3-dimethylcyclobutan-1-amine is CCC1(N)CC(C)C1C.
What is the InChIKey of 1-ethyl-2,3-dimethylcyclobutan-1-amine?
The InChIKey is MPSRWWLCOAPZRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N/c1-4-8(9)5-6(2)7(8)3/h6-7H,4-5,9H2,1-3H3.
What are the key properties of 1-ethyl-2,3-dimethylcyclobutan-1-amine?
1-ethyl-2,3-dimethylcyclobutan-1-amine has a molecular weight of 127.23 g/mol, XLogP of 1.77, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2,3-dimethylcyclobutan-1-amine is sourced from PubChem (CID 123756966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).